Hyrtial
[CAS# 97889-56-0]

Identification

• Name: Hyrtial
• Synonyms: Acetic Acid [(4As,4Br,6R,6Ar,10As,10Br,12As)-8-Formyl-1,1,4A,6A,10B-Pentamethyl-2,3,4,4B,5,6,7,10,10A,11,12,12A-Dodecahydrochrysen-6-Yl] Ester; [(4As,4Br,6R,6Ar,10As,10Br,12As)-8-Methanoyl-1,1,4A,6A,10B-Pentamethyl-2,3,4,4B,5,6,7,10,10A,11,12,12A-Dodecahyd
• Molecular Formula: C₂₆H₄₀O₃
• Molecular Weight: 400.60
• CAS Registry Number: 97889-56-0
• SMILES: [C@@H]13[C@]([C@H]2[C@]([C@H](OC(=O)C)C1)(CC(=CC2)C=O)C)(CC[C@@H]4[C@@]3(CCCC4(C)C)C)C
• InChI: 1S/C26H40O3/c1-17(28)29-22-14-21-24(4)12-7-11-23(2,3)19(24)10-13-25(21,5)20-9-8-18(16-27)15-26(20,22)6/h8,16,19-22H,7,9-15H2,1-6H3/t19-,20-,21+,22+,24-,25-,26+/m0/s1
• InChIKey: PTMXVTMFEPDKJQ-GAZMYWJLSA-N

Properties

• Density: 1.063g/cm³ (Cal.)
• Boiling point: 469.706°C at 760 mmHg (Cal.)
• Flash point: 198.339°C (Cal.)